1-Homoveratryl-3-[4-(4-methoxyphenyl)piperazino]pyrrolidine-2,5-quinone

SpectraBase Compound ID	1qmTKM0ljEs
InChI	InChI=1S/C25H31N3O5/c1-31-20-7-5-19(6-8-20)26-12-14-27(15-13-26)21-17-24(29)28(25(21)30)11-10-18-4-9-22(32-2)23(16-18)33-3/h4-9,16,21H,10-15,17H2,1-3H3
InChIKey	BKXPHEILLJNLNP-UHFFFAOYSA-N Google Search
Mol Weight	453.54 g/mol
Molecular Formula	C25H31N3O5
Exact Mass	453.226371 g/mol

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SpectraBase Spectrum ID	AW2L3Dqe7Mj
Name	1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(4-methoxyphenyl)-1-piperazinyl]-2,5-pyrrolidinedione
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C25H31N3O5/c1-31-20-7-5-19(6-8-20)26-12-14-27(15-13-26)21-17-24(29)28(25(21)30)11-10-18-4-9-22(32-2)23(16-18)33-3/h4-9,16,21H,10-15,17H2,1-3H3
InChIKey	BKXPHEILLJNLNP-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_7887
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: 127842; Labnumber: VLMP-0714; VK_ID: VK-007891
Temperature	308 °C